2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one

C16H27NO2 — CID 11184677

IUPAC2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one
SMILESO=C1CCCCC1C1(N2CCOCC2)CCCCC1
InChIInChI=1S/C16H27NO2/c18-15-7-3-2-6-14(15)16(8-4-1-5-9-16)17-10-12-19-13-11-17/h14H,1-13H2
InChIKeyGJAXYAGVKHHDNK-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.78
Rot. Bonds2

About 2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one

2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one (PubChem CID 11184677) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one.

Molecular Properties

Compound Name2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one
PubChem CID11184677
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one
SMILESO=C1CCCCC1C1(N2CCOCC2)CCCCC1
InChIInChI=1S/C16H27NO2/c18-15-7-3-2-6-14(15)16(8-4-1-5-9-16)17-10-12-19-13-11-17/h14H,1-13H2
InChIKeyGJAXYAGVKHHDNK-UHFFFAOYSA-N
XLogP2.78
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one?
The IUPAC name of 2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one (CID 11184677) is 2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one.
What is the SMILES notation for 2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one?
The canonical SMILES for 2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one is O=C1CCCCC1C1(N2CCOCC2)CCCCC1.
What is the InChIKey of 2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one?
The InChIKey is GJAXYAGVKHHDNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c18-15-7-3-2-6-14(15)16(8-4-1-5-9-16)17-10-12-19-13-11-17/h14H,1-13H2.
What are the key properties of 2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one?
2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one has a molecular weight of 265.40 g/mol, XLogP of 2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-morpholin-4-ylcyclohexyl)cyclohexan-1-one is sourced from PubChem (CID 11184677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).